[4-(2-cyanophenyl)phenyl]methyl 3,5-diacetamidobenzoate

Systemtic Name: [4-(2-cyanophenyl)phenyl]methyl 3,5-diacetamidobenzoate Openeye Name: [4-(2-cyanophenyl)phenyl]methyl 3,5-diacetamidobenzoate CAS Name: 3,5-diacetamidobenzoic acid [4-(2-cyanophenyl)phenyl]methyl ester IUPAC Name: [4-(2-cyanophenyl)phenyl]methyl 3,5-diacetamidobenzoate Traditional Name: 3,5-diacetamidobenzoic acid [4-(2-cyanophenyl)benzyl] ester Formula: C25H21N3O4 MolecularWeight: 427.45194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)NC(=O)C

Isomeric SMILES

CC(=O)NC1=CC(=CC(=C1)C(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3C#N)NC(=O)C

InChI

InChI=1S/C25H21N3O4/c1-16(29)27-22-11-21(12-23(13-22)28-17(2)30)25(31)32-15-18-7-9-19(10-8-18)24-6-4-3-5-20(24)14-26/h3-13H,15H2,1-2H3,(H,27,29)(H,28,30)